Base information
| Cat. No. | |
| CAS No. | 53101-02-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H10BrNO2S |
| Molecular Weight | 312.182 |
| Exact Mass | 310.962 |
| XLogP3 | 3.7493 |
| Mr | 71.3365 |
| PSA | 67.43 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 28 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)c1scc(n1)c1ccc(cc1)Br |
